Vitas-M small molecule compound

10-(naphthalen-1-yl)-9,11-dioxo-N-[3-(trifluoromethyl)phenyl]-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide

Catalog ID
STL051670
SMILES O=C(C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)Nc1cccc(c1)C(F)(F)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C32H22F3N3O3 MW 553.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22F3N3O3/c33-32(34,35)20-10-6-11-21(17-20)36-29(39)28-26-25(27-23-13-4-2-8-19(23)15-16-37(27)28)30(40)38(31(26)41)24-14-5-9-18-7-1-3-12-22(18)24/h1-17,25-28H,(H,36,39)
InChIKey
DPJKNKLGQZQEMQ-UHFFFAOYSA-N
Synonyms

(8S8aR11aS)10(naphthalen1yl)911dioxoN(3(trifluoromethyl)phenyl)8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
10(naphthalen1yl)911dioxoN(3(trifluoromethyl)phenyl)8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)NC5=CC=CC(=C5)C(F)(F)F)C(=O)N(C4=O)C6=CC=CC7=CC=CC=C76
InChI=1SC32H22F3N3O3c3332(3435)201061121(1720)3629(39)282625(27231342819(23)151637(27)28)30(40)38(31(26)41)241459187131222(18)24h1172528H(H3639)
MFCD05738275
O=C((C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3)Nc1cccc(c1)C(F)(F)F
ZINC000102889189
ZINC000102889196

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Available files

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